tetradecyl 3-[4-(diethylamino)-2-ethoxy-phenyl]-3-(1-ethyl-2-methyl-indol-3-yl)-1-oxidanylidene-2-benzofuran-5-carboxylate

Systemtic Name: tetradecyl 3-[4-(diethylamino)-2-ethoxy-phenyl]-3-(1-ethyl-2-methyl-indol-3-yl)-1-oxidanylidene-2-benzofuran-5-carboxylate Openeye Name: tetradecyl 3-[4-(diethylamino)-2-ethoxy-phenyl]-3-(1-ethyl-2-methyl-indol-3-yl)-1-oxo-isobenzofuran-5-carboxylate CAS Name: 3-[4-(diethylamino)-2-ethoxyphenyl]-3-(1-ethyl-2-methyl-3-indolyl)-1-oxo-5-isobenzofurancarboxylic acid tetradecyl ester IUPAC Name: tetradecyl 3-[4-(diethylamino)-2-ethoxyphenyl]-3-(1-ethyl-2-methylindol-3-yl)-1-oxo-2-benzofuran-5-carboxylate Traditional Name: 3-[4-(diethylamino)-2-ethoxy-phenyl]-3-(1-ethyl-2-methyl-indol-3-yl)-1-keto-phthalan-5-carboxylic acid myristyl ester Formula: C46H62N2O5 MolecularWeight: 722.99488

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCOC(=O)C1=CC2=C(C=C1)C(=O)OC2(C3=C(C=C(C=C3)N(CC)CC)OCC)C4=C(N(C5=CC=CC=C54)CC)C

Isomeric SMILES

CCCCCCCCCCCCCCOC(=O)C1=CC2=C(C=C1)C(=O)OC2(C3=C(C=C(C=C3)N(CC)CC)OCC)C4=C(N(C5=CC=CC=C54)CC)C

InChI

InChI=1S/C46H62N2O5/c1-7-12-13-14-15-16-17-18-19-20-21-24-31-52-44(49)35-27-29-37-40(32-35)46(53-45(37)50,43-34(6)48(10-4)41-26-23-22-25-38(41)43)39-30-28-36(47(8-2)9-3)33-42(39)51-11-5/h22-23,25-30,32-33H,7-21,24,31H2,1-6H3